PUBCHEM-ZINC03660497 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0060 1.4700 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 0.0750 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -0.5530 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 0.1910 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 1.5270 0.3830 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 2.1390 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 -0.7330 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -0.4210 0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 -1.9900 0.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -1.9500 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -2.8670 0.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 -3.2130 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -3.7640 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 -5.0300 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1730 -5.5360 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3850 -5.5490 2.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 -6.7670 2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 -7.2040 3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2950 -8.4630 3.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6970 -8.3900 3.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4660 -9.5520 4.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8290 -10.7920 4.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4390 -10.8880 4.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 -9.7220 3.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8270 -12.2960 4.2420 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9870 -13.3120 3.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0350 -11.9580 3.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0490 -12.5030 5.8040 N 0 5 0 0 0 0 0 0 0 0 0 0 9.1430 -12.6750 6.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 2.0330 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -0.4820 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 3.2240 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 -3.9510 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 -2.9950 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 -3.0240 1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2720 -3.9840 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 -5.0750 3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 -7.5480 1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1140 -6.5760 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9770 -6.3970 4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5210 -7.3560 4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1980 -7.4250 3.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5490 -9.4880 4.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -11.8580 4.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5920 -9.8020 3.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 3 4 2 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 2 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 28 -1 M END